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Home > Aldehydes > 893737-34-3
893737-34-3 | Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS No: 893737-34-3 Catalog No: AG00694M MDL No:
Product Description
Catalog Number:
AG00694M
Chemical Name:
Benzaldehyde,3-(2,3-dihydro-1,4-benzodioxin-6-yl)-
CAS Number:
893737-34-3
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
IUPAC Name:
3-(1H-indol-4-yl)benzaldehyde
InChI:
InChI=1S/C15H11NO/c17-10-11-3-1-4-12(9-11)13-5-2-6-15-14(13)7-8-16-15/h1-10,16H
InChI Key:
OYCWAHMMGPFEOW-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cccc2c1cc[nH]2
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.084g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.259g/mol
Monoisotopic Mass:
221.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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